1-(4-cyclopropylphenyl)-2-(2,5-difluorophenyl)ethanol

C17H16F2O — CID 79980804

IUPAC1-(4-cyclopropylphenyl)-2-(2,5-difluorophenyl)ethanol
SMILESOC(Cc1cc(F)ccc1F)c1ccc(C2CC2)cc1
InChIInChI=1S/C17H16F2O/c18-15-7-8-16(19)14(9-15)10-17(20)13-5-3-12(4-6-13)11-1-2-11/h3-9,11,17,20H,1-2,10H2
InChIKeyGIYLVUZKANZSPO-UHFFFAOYSA-N
MW274.31 g/mol
LogP4.12
Rot. Bonds4

About 1-(4-cyclopropylphenyl)-2-(2,5-difluorophenyl)ethanol

1-(4-cyclopropylphenyl)-2-(2,5-difluorophenyl)ethanol (PubChem CID 79980804) has the molecular formula C17H16F2O and a molecular weight of 274.31 g/mol. Its IUPAC name is 1-(4-cyclopropylphenyl)-2-(2,5-difluorophenyl)ethanol.

Molecular Properties

Compound Name1-(4-cyclopropylphenyl)-2-(2,5-difluorophenyl)ethanol
PubChem CID79980804
Molecular FormulaC17H16F2O
Molecular Weight274.31 g/mol
Exact Mass274.12
IUPAC Name1-(4-cyclopropylphenyl)-2-(2,5-difluorophenyl)ethanol
SMILESOC(Cc1cc(F)ccc1F)c1ccc(C2CC2)cc1
InChIInChI=1S/C17H16F2O/c18-15-7-8-16(19)14(9-15)10-17(20)13-5-3-12(4-6-13)11-1-2-11/h3-9,11,17,20H,1-2,10H2
InChIKeyGIYLVUZKANZSPO-UHFFFAOYSA-N
XLogP4.12
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.31
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(5-bromo-2-fluorophenyl)-1-(4-cyclopropylphenyl)ethanol
CID 79980726
1-(4-cyclopropylphenyl)-2-(2,6-difluorophenyl)ethanol
CID 114931089
1-[4-(difluoromethoxy)phenyl]-2-(2,5-difluorophenyl)ethanol
CID 63893268
2-(4-chloro-3-fluorophenyl)-1-(4-cyclopropylphenyl)ethanol
CID 107883644
2-(3-bromo-5-fluorophenyl)-1-(4-cyclopropylphenyl)ethanol
CID 79979846
1-(4-cyclopropylphenyl)-2-(3-fluoro-4-methoxyphenyl)ethanol
CID 79973379
2-(2,5-difluorophenyl)-1-naphthalen-2-ylethanol
CID 62716910
2-(2,5-difluorophenyl)-1-pyridazin-4-ylethanol
CID 105081030
2-(5-bromo-2-fluorophenyl)-1-(3-cyclopropylphenyl)ethanol
CID 79980480
1-cyclopropyl-3-(2,5-difluorophenyl)propane-1,2-diol
CID 103456708
1-[3-(difluoromethyl)phenyl]-2-(2,5-difluorophenyl)ethanol
CID 115527686
1-(4-chloro-3-methylphenyl)-2-(2,5-difluorophenyl)ethanol
CID 114982155

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclopropylphenyl)-2-(2,5-difluorophenyl)ethanol?
The IUPAC name of 1-(4-cyclopropylphenyl)-2-(2,5-difluorophenyl)ethanol (CID 79980804) is 1-(4-cyclopropylphenyl)-2-(2,5-difluorophenyl)ethanol.
What is the SMILES notation for 1-(4-cyclopropylphenyl)-2-(2,5-difluorophenyl)ethanol?
The canonical SMILES for 1-(4-cyclopropylphenyl)-2-(2,5-difluorophenyl)ethanol is OC(Cc1cc(F)ccc1F)c1ccc(C2CC2)cc1.
What is the InChIKey of 1-(4-cyclopropylphenyl)-2-(2,5-difluorophenyl)ethanol?
The InChIKey is GIYLVUZKANZSPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16F2O/c18-15-7-8-16(19)14(9-15)10-17(20)13-5-3-12(4-6-13)11-1-2-11/h3-9,11,17,20H,1-2,10H2.
What are the key properties of 1-(4-cyclopropylphenyl)-2-(2,5-difluorophenyl)ethanol?
1-(4-cyclopropylphenyl)-2-(2,5-difluorophenyl)ethanol has a molecular weight of 274.31 g/mol, XLogP of 4.12, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclopropylphenyl)-2-(2,5-difluorophenyl)ethanol is sourced from PubChem (CID 79980804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).